N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide

Systemtic Name: N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Openeye Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide CAS Name: N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-[2-(dimethylamino)-2-thiophen-3-ylethyl]-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Formula: C22H24N4O5S2 MolecularWeight: 488.57976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NCC(C3=CSC=C3)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NCC(C3=CSC=C3)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O5S2/c1-15-4-9-19(12-20(15)26(28)29)33(30,31)24-18-7-5-16(6-8-18)22(27)23-13-21(25(2)3)17-10-11-32-14-17/h4-12,14,21,24H,13H2,1-3H3,(H,23,27)